How to build Amber

Software
Version
Cluster
Amber
22
Dardel-GPU

The tool was installed using EasyBuild https://docs.easybuild.io/en/latest/

module load PDC
module load easybuild-user
eb amber/22-cpeGNU-22.06-ambertools-22-gpu

Disclaimer

PDC takes no responsibility for the correctness of results produced with the binaries. Always evaluate the binaries against known results for the systems and properties you are investigating before using the binaries for production jobs.

How to use Amber